Target Information
| Target General Information | Top | |||||
|---|---|---|---|---|---|---|
| Target ID |
T37693
(Former ID: TTDC00314)
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| Target Name |
Cannabinoid receptor 2 (CB2)
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| Synonyms |
hCB2; Cannabinoid CB2 receptor; CX5; CB2B; CB2A; CB-2
Click to Show/Hide
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| Gene Name |
CNR2
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| Target Type |
Successful target
|
[1] | ||||
| Disease | [+] 2 Target-related Diseases | + | ||||
| 1 | Attention deficit hyperactivity disorder [ICD-11: 6A05] | |||||
| 2 | Insomnia [ICD-11: 7A00-7A0Z] | |||||
| Function |
May function in inflammatory response, nociceptive transmission and bone homeostasis. Heterotrimeric G protein-coupled receptor for endocannabinoid 2-arachidonoylglycerol mediating inhibition of adenylate cyclase.
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| BioChemical Class |
GPCR rhodopsin
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| UniProt ID | ||||||
| Sequence |
MEECWVTEIANGSKDGLDSNPMKDYMILSGPQKTAVAVLCTLLGLLSALENVAVLYLILS
SHQLRRKPSYLFIGSLAGADFLASVVFACSFVNFHVFHGVDSKAVFLLKIGSVTMTFTAS VGSLLLTAIDRYLCLRYPPSYKALLTRGRALVTLGIMWVLSALVSYLPLMGWTCCPRPCS ELFPLIPNDYLLSWLLFIAFLFSGIIYTYGHVLWKAHQHVASLSGHQDRQVPGMARMRLD VRLAKTLGLVLAVLLICWFPVLALMAHSLATTLSDQVKKAFAFCSMLCLINSMVNPVIYA LRSGEIRSSAHHCLAHWKKCVRGLGSEAKEEAPRSSVTETEADGKITPWPDSRDLDLSDC Click to Show/Hide
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| 3D Structure | Click to Show 3D Structure of This Target | PDB | ||||
| HIT2.0 ID | T95LIF | |||||
| Drugs and Modes of Action | Top | |||||
|---|---|---|---|---|---|---|
| Approved Drug(s) | [+] 2 Approved Drugs | + | ||||
| 1 | Guanfacine extended release | Drug Info | Approved | Attention deficit hyperactivity disorder | [2] | |
| 2 | NABILONE | Drug Info | Approved | Insomnia | [3] | |
| Clinical Trial Drug(s) | [+] 10 Clinical Trial Drugs | + | ||||
| 1 | 842166X | Drug Info | Phase 2 | Pain | [4] | |
| 2 | APD371 | Drug Info | Phase 2 | Crohn disease | [5] | |
| 3 | Beta-caryophyllene | Drug Info | Phase 2 | Pain | [6] | |
| 4 | GW-42004 | Drug Info | Phase 2 | Lipid metabolism disorder | [7] | |
| 5 | KHK-6188 | Drug Info | Phase 2 | Neuropathic pain | [8] | |
| 6 | LY-2828360 | Drug Info | Phase 2 | Pain | [9] | |
| 7 | S-777469 | Drug Info | Phase 2 | Atopic dermatitis | [10] | |
| 8 | Vicasinabin | Drug Info | Phase 2 | Diabetic retinopathy | [11] | |
| 9 | NTRX-07 | Drug Info | Phase 1 | Alzheimer disease | [12] | |
| 10 | Tedalinab | Drug Info | Phase 1 | Pain | [13] | |
| Patented Agent(s) | [+] 11 Patented Agents | + | ||||
| 1 | Isoquinoline derivative 1 | Drug Info | Patented | Neuropathic pain | [14] | |
| 2 | Isoquinoline derivative 2 | Drug Info | Patented | Neuropathic pain | [14] | |
| 3 | Isoquinoline derivative 3 | Drug Info | Patented | Neuropathic pain | [14] | |
| 4 | JWH-015 | Drug Info | Patented | Organ transplant rejection | [14] | |
| 5 | N,N-methylenebis-2-phenylacetamide and benzenesulfonamide derivative 1 | Drug Info | Patented | Osteoporosis | [14] | |
| 6 | N,N-methylenebis-2-phenylacetamide and benzenesulfonamide derivative 2 | Drug Info | Patented | Osteoporosis | [14] | |
| 7 | N,N-methylenebis-2-phenylacetamide and benzenesulfonamide derivative 3 | Drug Info | Patented | Osteoporosis | [14] | |
| 8 | PMID27215781-Compound-28 | Drug Info | Patented | Endometriosis | [14] | |
| 9 | PMID27215781-Compound-37 | Drug Info | Patented | Prostate cancer | [14] | |
| 10 | Tricyclic phytocannabinoid derivative 1 | Drug Info | Patented | Neuropathic pain | [14] | |
| 11 | Tricyclic phytocannabinoid derivative 2 | Drug Info | Patented | Neuropathic pain | [14] | |
| Discontinued Drug(s) | [+] 6 Discontinued Drugs | + | ||||
| 1 | KN-38-7271 | Drug Info | Discontinued in Phase 2 | Ischemia | [15] | |
| 2 | PRS-211375 iv | Drug Info | Discontinued in Phase 2 | Pain | [16], [17] | |
| 3 | TAK-937 | Drug Info | Discontinued in Phase 1 | Cerebrovascular ischaemia | [18] | |
| 4 | AM-577 | Drug Info | Terminated | Pain | [19] | |
| 5 | PRS-639058 | Drug Info | Terminated | Neuropathic pain | [17] | |
| 6 | PXS-2076 | Drug Info | Terminated | Rheumatoid arthritis | [20] | |
| Mode of Action | [+] 5 Modes of Action | + | ||||
| Agonist | [+] 38 Agonist drugs | + | ||||
| 1 | Guanfacine extended release | Drug Info | [1] | |||
| 2 | 842166X | Drug Info | [22] | |||
| 3 | APD371 | Drug Info | [5] | |||
| 4 | Beta-caryophyllene | Drug Info | [23] | |||
| 5 | KHK-6188 | Drug Info | [25] | |||
| 6 | LY-2828360 | Drug Info | [25] | |||
| 7 | S-777469 | Drug Info | [10] | |||
| 8 | Vicasinabin | Drug Info | [11] | |||
| 9 | NTRX-07 | Drug Info | [26] | |||
| 10 | Tedalinab | Drug Info | [27] | |||
| 11 | Adamantyl derivative 1 | Drug Info | [14] | |||
| 12 | Carbazole-3-carboxamide analog 1 | Drug Info | [14] | |||
| 13 | Cyano(dimethyl)methyl isoxazoles and [1,3,4]-thiadiazoles derivative 1 | Drug Info | [14] | |||
| 14 | Cyano(dimethyl)methyl isoxazoles and [1,3,4]-thiadiazoles derivative 2 | Drug Info | [14] | |||
| 15 | JWH-015 | Drug Info | [1], [14] | |||
| 16 | PMID27215781-Compound-19 | Drug Info | [14] | |||
| 17 | PMID27215781-Compound-2 | Drug Info | [14] | |||
| 18 | PMID27215781-Compound-25 | Drug Info | [14] | |||
| 19 | PMID27215781-Compound-27 | Drug Info | [14] | |||
| 20 | PMID27215781-Compound-28 | Drug Info | [14] | |||
| 21 | PMID27215781-Compound-29 | Drug Info | [14] | |||
| 22 | PMID27215781-Compound-30 | Drug Info | [14] | |||
| 23 | PMID27215781-Compound-31 | Drug Info | [14] | |||
| 24 | PMID27215781-Compound-4 | Drug Info | [14] | |||
| 25 | PRS-211375 iv | Drug Info | [29] | |||
| 26 | AM-577 | Drug Info | [31] | |||
| 27 | PRS-639058 | Drug Info | [32] | |||
| 28 | PXS-2076 | Drug Info | [33] | |||
| 29 | AR-XYZ | Drug Info | [33] | |||
| 30 | JWH-051 | Drug Info | [33] | |||
| 31 | L-759,633 | Drug Info | [33] | |||
| 32 | L-759,656 | Drug Info | [33] | |||
| 33 | MDA-19 | Drug Info | [33] | |||
| 34 | RQ-00202730 | Drug Info | [33] | |||
| 35 | Sch-036 | Drug Info | [33] | |||
| 36 | [3H]CP55940 | Drug Info | [69], [70] | |||
| 37 | [3H]HU-243 | Drug Info | [71] | |||
| 38 | [3H]WIN55212-2 | Drug Info | [72] | |||
| Inhibitor | [+] 161 Inhibitor drugs | + | ||||
| 1 | NABILONE | Drug Info | [21] | |||
| 2 | WIN-55212-2 | Drug Info | [34] | |||
| 3 | (1R,2R)-N-Arachidonoylcyclopropanolamide | Drug Info | [35] | |||
| 4 | (1R,2S)-N-Arachidonoylcyclopropanolamide | Drug Info | [35] | |||
| 5 | (1R,2S)-N-Oleoylcyclopropanolamide | Drug Info | [35] | |||
| 6 | (1S,2S)-N-Arachidonoylcyclopropanolamide | Drug Info | [35] | |||
| 7 | (1S,2S)-N-Oleoylcyclopropanolamide | Drug Info | [35] | |||
| 8 | (2R)-N-(6-(4-CHLOROPHENYL)-7-(2,4-DICHLOROPHENYL)-2,2-DIMETHYL-3,4-DIHYDRO-2H-PYRANO[2,3-B]PYRIDIN-4-YL)-2-HYDROXYPROPANAMIDE (ENANTIOMERIC MIX) | Drug Info | [36] | |||
| 9 | (2R)-N-(7'-(2-CHLOROPHENYL)-6'-(4-CHLOROPHENYL)-3',4'-DIHYDROSPIRO[CYCLOHEXANE-1,2'-PYRANO[2,3-B]PYRIDINE]-4'-YL)-2-HYDROXYPROPANAMIDE (ENANTIOMERIC MIX) | Drug Info | [36] | |||
| 10 | (2S)-N-(7'-(2-CHLOROPHENYL)-6'-(4-CHLOROPHENYL)-3',4'-DIHYDROSPIRO[CYCLOHEXANE-1,2'-PYRANO[2,3-B]PYRIDINE]-4'-YL)-2-HYDROXYPROPANAMIDE (ENANTIOMERIC MIX) | Drug Info | [36] | |||
| 11 | (4-benzhydrylpiperazin-1-yl)(cyclohexyl)methanone | Drug Info | [37] | |||
| 12 | (E)-N-(3,5-dimethoxyphenethyl)undec-2-enamide | Drug Info | [38] | |||
| 13 | (E)-N-(4-methoxyphenethyl)undec-2-enamide | Drug Info | [38] | |||
| 14 | (E)-N-(4-methoxyphenyl)undec-2-enamide | Drug Info | [38] | |||
| 15 | 1,4-dihydroindeno[1,2-c]-pyrazole | Drug Info | [39] | |||
| 16 | 2'-amino-4-(1,1-dimethyl-heptyl)-biphenyl-2-ol | Drug Info | [40] | |||
| 17 | 2-(2-Methoxybenzyl)-3H-benzo[f]chromen-3-one | Drug Info | [41] | |||
| 18 | 3'-amino-4-(1,1-dimethyl-heptyl)-biphenyl-2-ol | Drug Info | [40] | |||
| 19 | 3,4-diarylpyrazoline derivative | Drug Info | [42] | |||
| 20 | 3-benzoyl-1-pentyl-1,4-dihydroquinolin-4-one | Drug Info | [43] | |||
| 21 | 3-Benzyl-5-isopropyl-8-methylchromen-2-one | Drug Info | [41] | |||
| 22 | 4'-(1,1-dimethyl-heptyl)-3,5-dimethyl-biphenyl | Drug Info | [40] | |||
| 23 | 4'-amino-4-(1,1-dimethyl-heptyl)-biphenyl-2-ol | Drug Info | [40] | |||
| 24 | 4-(1,1-dimethyl-heptyl)-2'-methoxy-biphenyl-2-ol | Drug Info | [40] | |||
| 25 | 4-(1,1-dimethyl-heptyl)-3'-methoxy-biphenyl-2-ol | Drug Info | [40] | |||
| 26 | 4-benzhydryl-N-butylpiperazine-1-carboxamide | Drug Info | [37] | |||
| 27 | 4-benzhydryl-N-cyclohexylpiperazine-1-carboxamide | Drug Info | [37] | |||
| 28 | 5-(1,1-dimethyl-heptyl)-2-pyridin-3-yl-phenol | Drug Info | [40] | |||
| 29 | 5-Biphenyl-4-ylmethyl-1-isobutyl-1H-tetrazole | Drug Info | [44] | |||
| 30 | 5-Biphenyl-4-ylmethyl-2-isobutyl-2H-tetrazole | Drug Info | [44] | |||
| 31 | 5-Methoxy-3-(2-methoxybenzyl)-2H-chromen-2-one | Drug Info | [41] | |||
| 32 | 6-(4-CHLOROPHENYL)-7-(2,4-DICHLOROPHENYL)-2,2-DIMETHYL-3,4-DIHYDRO-2H-PYRANO[2,3-B]PYRIDINE-4-CARBOXAMIDE (ENANTIOMERIC MIX) | Drug Info | [36] | |||
| 33 | 6-(4-CHLOROPHENYL)-7-(2,4-DICHLOROPHENYL)-N-((R)-1-HYDROXYETHYL)-1,2,2-TRIMETHYL-1,2,3,4-TETRAHYDRO-1,8-NAPHTHYRIDINE-4-CARBOXAMIDE (ENANTIOMERIC MIX) | Drug Info | [36] | |||
| 34 | 6-(4-CHLOROPHENYL)-7-(2,4-DICHLOROPHENYL)-N-(1-HYDROXY-2-METHYLPROPAN-2-YL)-2,2-DIMETHYL-3,4-DIHYDRO-2H-PYRANO[2,3-B]PYRIDINE-4-CARBOXAMIDE (ENANTIOMERIC MIX) | Drug Info | [36] | |||
| 35 | 6-(4-CHLOROPHENYL)-7-(2,4-DICHLOROPHENYL)-N-(HYDROXYMETHYL)-1,2,2-TRIMETHYL-1,2,3,4-TETRAHYDRO-1,8-NAPHTHYRIDINE-4-CARBOXAMIDE (ENANTIOMERIC MIX) | Drug Info | [36] | |||
| 36 | A-796260 | Drug Info | [45] | |||
| 37 | AM-1241 | Drug Info | [45] | |||
| 38 | AM-1710 | Drug Info | [46] | |||
| 39 | AM-1714 | Drug Info | [46] | |||
| 40 | AM-1715 | Drug Info | [46] | |||
| 41 | AM-281 | Drug Info | [41] | |||
| 42 | AM-404 | Drug Info | [47] | |||
| 43 | AM-411 | Drug Info | [48] | |||
| 44 | AM-4768 | Drug Info | [46] | |||
| 45 | AM-630 | Drug Info | [49] | |||
| 46 | Cis-N-oleoylcyclopropanolamide | Drug Info | [35] | |||
| 47 | DELTA 8-TETRAHYDROCANNOBINOL | Drug Info | [50] | |||
| 48 | Dodeca-2E,4E-dienoic acid isobutylamide | Drug Info | [51] | |||
| 49 | GNF-PF-5188 | Drug Info | [52] | |||
| 50 | JWH-120 | Drug Info | [52] | |||
| 51 | JWH-133 | Drug Info | [53] | |||
| 52 | JWH-145 | Drug Info | [54] | |||
| 53 | JWH-146 | Drug Info | [54] | |||
| 54 | JWH-147 | Drug Info | [54] | |||
| 55 | JWH-150 | Drug Info | [54] | |||
| 56 | JWH-151 | Drug Info | [52] | |||
| 57 | JWH-156 | Drug Info | [54] | |||
| 58 | JWH-167 | Drug Info | [55] | |||
| 59 | JWH-201 | Drug Info | [55] | |||
| 60 | JWH-202 | Drug Info | [55] | |||
| 61 | JWH-203 | Drug Info | [55] | |||
| 62 | JWH-204 | Drug Info | [55] | |||
| 63 | JWH-205 | Drug Info | [55] | |||
| 64 | JWH-206 | Drug Info | [55] | |||
| 65 | JWH-207 | Drug Info | [55] | |||
| 66 | JWH-208 | Drug Info | [55] | |||
| 67 | JWH-209 | Drug Info | [55] | |||
| 68 | JWH-229 | Drug Info | [52] | |||
| 69 | JWH-237 | Drug Info | [55] | |||
| 70 | JWH-243 | Drug Info | [54] | |||
| 71 | JWH-244 | Drug Info | [54] | |||
| 72 | JWH-245 | Drug Info | [54] | |||
| 73 | JWH-246 | Drug Info | [54] | |||
| 74 | JWH-248 | Drug Info | [55] | |||
| 75 | JWH-249 | Drug Info | [55] | |||
| 76 | JWH-250 | Drug Info | [55] | |||
| 77 | JWH-251 | Drug Info | [55] | |||
| 78 | JWH-252 | Drug Info | [55] | |||
| 79 | JWH-253 | Drug Info | [55] | |||
| 80 | JWH-268 | Drug Info | [52] | |||
| 81 | JWH-292 | Drug Info | [54] | |||
| 82 | JWH-293 | Drug Info | [54] | |||
| 83 | JWH-294 | Drug Info | [56] | |||
| 84 | JWH-295 | Drug Info | [56] | |||
| 85 | JWH-296 | Drug Info | [56] | |||
| 86 | JWH-297 | Drug Info | [56] | |||
| 87 | JWH-302 | Drug Info | [55] | |||
| 88 | JWH-303 | Drug Info | [55] | |||
| 89 | JWH-305 | Drug Info | [55] | |||
| 90 | JWH-306 | Drug Info | [55] | |||
| 91 | JWH-307 | Drug Info | [54] | |||
| 92 | JWH-308 | Drug Info | [54] | |||
| 93 | JWH-309 | Drug Info | [54] | |||
| 94 | JWH-311 | Drug Info | [55] | |||
| 95 | JWH-312 | Drug Info | [55] | |||
| 96 | JWH-313 | Drug Info | [55] | |||
| 97 | JWH-314 | Drug Info | [55] | |||
| 98 | JWH-315 | Drug Info | [55] | |||
| 99 | JWH-323 | Drug Info | [56] | |||
| 100 | JWH-324 | Drug Info | [57] | |||
| 101 | JWH-325 | Drug Info | [56] | |||
| 102 | JWH-337 | Drug Info | [56] | |||
| 103 | JWH-342 | Drug Info | [56] | |||
| 104 | JWH-343 | Drug Info | [56] | |||
| 105 | JWH-344 | Drug Info | [56] | |||
| 106 | JWH-345 | Drug Info | [56] | |||
| 107 | JWH-346 | Drug Info | [54] | |||
| 108 | JWH-347 | Drug Info | [54] | |||
| 109 | JWH-348 | Drug Info | [54] | |||
| 110 | JWH-363 | Drug Info | [54] | |||
| 111 | JWH-364 | Drug Info | [54] | |||
| 112 | JWH-365 | Drug Info | [54] | |||
| 113 | JWH-366 | Drug Info | [54] | |||
| 114 | JWH-367 | Drug Info | [54] | |||
| 115 | JWH-368 | Drug Info | [54] | |||
| 116 | JWH-369 | Drug Info | [54] | |||
| 117 | JWH-370 | Drug Info | [54] | |||
| 118 | JWH-371 | Drug Info | [54] | |||
| 119 | JWH-372 | Drug Info | [54] | |||
| 120 | JWH-373 | Drug Info | [54] | |||
| 121 | JWH-385 | Drug Info | [56] | |||
| 122 | JWH-392 | Drug Info | [56] | |||
| 123 | JWH-401 | Drug Info | [56] | |||
| 124 | JWH-402 | Drug Info | [56] | |||
| 125 | JWH-403 | Drug Info | [56] | |||
| 126 | JWH-404 | Drug Info | [56] | |||
| 127 | JWH-405 | Drug Info | [56] | |||
| 128 | JWH-406 | Drug Info | [56] | |||
| 129 | JWH-407 | Drug Info | [56] | |||
| 130 | JWH-440 | Drug Info | [57] | |||
| 131 | JWH-441 | Drug Info | [57] | |||
| 132 | JWH-442 | Drug Info | [57] | |||
| 133 | KM-233 | Drug Info | [58] | |||
| 134 | KM-233-M | Drug Info | [58] | |||
| 135 | N-(1H-indazol-5-yl)icosa-5,8,11,14-tetraenamide | Drug Info | [47] | |||
| 136 | N-(2-chloroethyl)icosa-5,8,11,14-tetraenamide | Drug Info | [49] | |||
| 137 | N-(3,3-Diphenyl)propyl-2,2-diphenylacetamide | Drug Info | [59] | |||
| 138 | N-(3-Phenyl)propyl-2-(4-bromophenylacetamide) | Drug Info | [59] | |||
| 139 | N-(4-hydroxybenzyl)icosa-5,8,11,14-tetraenamide | Drug Info | [47] | |||
| 140 | N-(6-(4-CHLOROPHENYL)-7-(2,4-DICHLOROPHENYL)-2,2-DIMETHYL-3,4-DIHYDRO-2H-PYRANO[2,3-B]PYRIDIN-4-YL)-2-HYDROXYACETAMIDE (ENANTIOMERIC MIX) | Drug Info | [36] | |||
| 141 | N-(6-(4-CHLOROPHENYL)-7-(2,4-DICHLOROPHENYL)-2,2-DIMETHYL-3,4-DIHYDRO-2H-PYRANO[2,3-B]PYRIDIN-4-YL)-3-HYDROXY-2,2-DIMETHYLPROPANAMIDE (ENANTIOMERIC MIX) | Drug Info | [36] | |||
| 142 | N-(6-(4-CHLOROPHENYL)-7-(2,4-DICHLOROPHENYL)-2,2-DIMETHYL-3,4-DIHYDRO-2H-PYRANO[2,3-B]PYRIDIN-4-YL)-3-HYDROXYPROPANAMIDE (ENANTIOMERIC MIX) | Drug Info | [36] | |||
| 143 | N-(7'-(2-CHLOROPHENYL)-6'-(4-CHLOROPHENYL)-3',4'-DIHYDROSPIRO[CYCLOHEXANE-1,2'-PYRANO[2,3-B]PYRIDINE]-4'-YL)-2-HYDROXY-2-METHYLPROPANAMIDE (ENANTIOMERIC MIX) | Drug Info | [36] | |||
| 144 | N-(7-(2-CHLOROPHENYL)-6-(4-CHLOROPHENYL)-2,2-DIMETHYL-3,4-DIHYDRO-2H-PYRANO[2,3-B]PYRIDIN-4-YL)-2-HYDROXYACETAMIDE (ENANTIOMERIC MIX) | Drug Info | [36] | |||
| 145 | N-arachidonoyl-N-(2-hydroxyethyl)hydroxylamine | Drug Info | [60] | |||
| 146 | N-arachidonoyl-O-(2-hydroxyethyl)hydroxylamine | Drug Info | [60] | |||
| 147 | N-benzyl-4-bromo-3-(morpholinosulfonyl)benzamide | Drug Info | [61] | |||
| 148 | N-oleoyl-N-(2-hydroxyethyl)hydroxylamine | Drug Info | [60] | |||
| 149 | N-oleoyl-O-(2-hydroxyethyl)hydroxylamine | Drug Info | [60] | |||
| 150 | N-[6-(4-CHLOROPHENYL)-7-(2,4-DICHLOROPHENYL)-2,2-DIMETHYL-3,4-DIHYDRO-2H-PYRANO[2,3-B]PYRIDINE-4-YL]-4,4,4-TRIFLUORO-3-HYDROXYBUTANAMIDE (DIASTEREOMERIC MIX) | Drug Info | [62] | |||
| 151 | N1-(4-bromophenyl)-N2,N2-dipentylphthalamide | Drug Info | [52] | |||
| 152 | NAPHTHYRIDINONE | Drug Info | [63] | |||
| 153 | O-arachidonoyl-N-(2-hydroxyethyl)hydroxylamine | Drug Info | [60] | |||
| 154 | O-oleoyl-N-(2-hydroxyethyl)hydroxylamine | Drug Info | [60] | |||
| 155 | PRAVADOLINE | Drug Info | [64] | |||
| 156 | Rac-cis-N-arachidonoylcyclopropanolamide | Drug Info | [35] | |||
| 157 | Rac-trans-N-oleoylcyclopropanolamide | Drug Info | [35] | |||
| 158 | SCH-225336 | Drug Info | [65] | |||
| 159 | SCH-356036 | Drug Info | [66] | |||
| 160 | VER-156084 | Drug Info | [68] | |||
| 161 | VER-156085 | Drug Info | [68] | |||
| Modulator | [+] 3 Modulator drugs | + | ||||
| 1 | GW-42004 | Drug Info | [24] | |||
| 2 | KN-38-7271 | Drug Info | [28] | |||
| 3 | TAK-937 | Drug Info | [30] | |||
| Activator | [+] 1 Activator drugs | + | ||||
| 1 | HU-433 | Drug Info | [33] | |||
| Antagonist | [+] 1 Antagonist drugs | + | ||||
| 1 | SR144528 | Drug Info | [67] | |||
| Cell-based Target Expression Variations | Top | |||||
|---|---|---|---|---|---|---|
| Cell-based Target Expression Variations | ||||||
| Drug Binding Sites of Target | Top | |||||
|---|---|---|---|---|---|---|
| Ligand Name: Cholesterol | Ligand Info | |||||
| Structure Description | Cryo-EM structure of human cannabinoid receptor 2-Gi protein in complex with agonist WIN 55,212-2 | PDB:6PT0 | ||||
| Method | Electron microscopy | Resolution | 3.20 Å | Mutation | Yes | [73] |
| PDB Sequence |
MKDYMILSGP
31 QKTAVAVLCT41 LLGLLSALEN51 VAVLYLILSS61 HQLRRKPSYL71 FIGSLAGADF 81 LASVVFACSF91 VNFHVFHGVD101 SKAVFLLKIG111 SVTMTFTASV121 GSLLLTAIDR 131 YLCLRYPPSY141 KALLTRGRAL151 VTLGIMWVLS161 ALVSYLPLMG171 WTCCPRPCSE 181 LFPLIPNDYL191 LSWLLFIAFL201 FSGIIYTYGH211 VLWKAHQHVA221 SLSGHQDRQV 231 PGMARMRLDV241 RLAKTLGLVL251 AVLLICWFPV261 LALMAHSLAT271 TLSDQVKKAF 281 AFCSMLCLIN291 SMVNPVIYAL301 RSGEIRSSAH311 HCLAHWKK
|
|||||
|
|
PHE72
4.198
LEU126
3.744
ILE129
3.763
ASP130
4.225
LEU133
3.751
TYR137
4.026
LEU144
3.601
LEU145
3.765
ARG149
3.892
THR153
3.743
GLY210
3.332
HIS211
4.680
LEU213
3.601
TRP214
3.720
HIS217
3.923
|
|||||
| Ligand Name: WIN-55212-2 | Ligand Info | |||||
| Structure Description | Cryo-EM structure of human cannabinoid receptor 2-Gi protein in complex with agonist WIN 55,212-2 | PDB:6PT0 | ||||
| Method | Electron microscopy | Resolution | 3.20 Å | Mutation | Yes | [73] |
| PDB Sequence |
MKDYMILSGP
31 QKTAVAVLCT41 LLGLLSALEN51 VAVLYLILSS61 HQLRRKPSYL71 FIGSLAGADF 81 LASVVFACSF91 VNFHVFHGVD101 SKAVFLLKIG111 SVTMTFTASV121 GSLLLTAIDR 131 YLCLRYPPSY141 KALLTRGRAL151 VTLGIMWVLS161 ALVSYLPLMG171 WTCCPRPCSE 181 LFPLIPNDYL191 LSWLLFIAFL201 FSGIIYTYGH211 VLWKAHQHVA221 SLSGHQDRQV 231 PGMARMRLDV241 RLAKTLGLVL251 AVLLICWFPV261 LALMAHSLAT271 TLSDQVKKAF 281 AFCSMLCLIN291 SMVNPVIYAL301 RSGEIRSSAH311 HCLAHWKK
|
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PHE87
3.513
SER90
3.216
PHE91
3.993
PHE94
3.440
HIS95
4.954
PHE106
4.752
ILE110
3.725
VAL113
4.389
THR114
3.291
PHE117
4.655
PRO168
4.946
LEU182
4.379
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| Click to View More Binding Site Information of This Target with Different Ligands | ||||||
| Different Human System Profiles of Target | Top |
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Human Similarity Proteins
of target is determined by comparing the sequence similarity of all human proteins with the target based on BLAST. The similarity proteins for a target are defined as the proteins with E-value < 0.005 and outside the protein families of the target.
A target that has fewer human similarity proteins outside its family is commonly regarded to possess a greater capacity to avoid undesired interactions and thus increase the possibility of finding successful drugs
(Brief Bioinform, 21: 649-662, 2020).
Human Pathway Affiliation
of target is determined by the life-essential pathways provided on KEGG database. The target-affiliated pathways were defined based on the following two criteria (a) the pathways of the studied target should be life-essential for both healthy individuals and patients, and (b) the studied target should occupy an upstream position in the pathways and therefore had the ability to regulate biological function.
Targets involved in a fewer pathways have greater likelihood to be successfully developed, while those associated with more human pathways increase the chance of undesirable interferences with other human processes
(Pharmacol Rev, 58: 259-279, 2006).
Human Similarity Proteins
Human Pathway Affiliation
|
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| KEGG Pathway | Pathway ID | Affiliated Target | Pathway Map |
|---|---|---|---|
| Neuroactive ligand-receptor interaction | hsa04080 | Affiliated Target |
|
| Class: Environmental Information Processing => Signaling molecules and interaction | Pathway Hierarchy | ||
| Chemical Structure based Activity Landscape of Target | Top |
|---|---|
| Drug Property Profile of Target | Top | |
|---|---|---|
| (1) Molecular Weight (mw) based Drug Clustering | (2) Octanol/Water Partition Coefficient (xlogp) based Drug Clustering | |
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| (3) Hydrogen Bond Donor Count (hbonddonor) based Drug Clustering | (4) Hydrogen Bond Acceptor Count (hbondacc) based Drug Clustering | |
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| (5) Rotatable Bond Count (rotbonds) based Drug Clustering | (6) Topological Polar Surface Area (polararea) based Drug Clustering | |
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| "RO5" indicates the cutoff set by lipinski's rule of five; "D123AB" colored in GREEN denotes the no violation of any cutoff in lipinski's rule of five; "D123AB" colored in PURPLE refers to the violation of only one cutoff in lipinski's rule of five; "D123AB" colored in BLACK represents the violation of more than one cutoffs in lipinski's rule of five | ||
| Co-Targets | Top | |||||
|---|---|---|---|---|---|---|
| Co-Targets | ||||||
| Target Poor or Non Binders | Top | |||||
|---|---|---|---|---|---|---|
| Target Poor or Non Binders | ||||||
| Target Regulators | Top | |||||
|---|---|---|---|---|---|---|
| Target-regulating microRNAs | ||||||
| Target Profiles in Patients | Top | |||||
|---|---|---|---|---|---|---|
| Target Expression Profile (TEP) | ||||||
| Target Affiliated Biological Pathways | Top | |||||
|---|---|---|---|---|---|---|
| KEGG Pathway | [+] 1 KEGG Pathways | + | ||||
| 1 | Neuroactive ligand-receptor interaction | |||||
| Reactome | [+] 2 Reactome Pathways | + | ||||
| 1 | Class A/1 (Rhodopsin-like receptors) | |||||
| 2 | G alpha (i) signalling events | |||||
| WikiPathways | [+] 4 WikiPathways | + | ||||
| 1 | GPCRs, Class A Rhodopsin-like | |||||
| 2 | Small Ligand GPCRs | |||||
| 3 | GPCR ligand binding | |||||
| 4 | GPCR downstream signaling | |||||
| Target-Related Models and Studies | Top | |||||
|---|---|---|---|---|---|---|
| Target Validation | ||||||
| Target QSAR Model | ||||||
| References | Top | |||||
|---|---|---|---|---|---|---|
| REF 1 | Posttraining activation of CB1 cannabinoid receptors in the CA1 region of the dorsal hippocampus impairs object recognition long-term memory. Neurobiol Learn Mem. 2008 Sep;90(2):374-81. | |||||
| REF 2 | Emerging drugs for attention-deficit/hyperactivity disorder. Expert Opin Emerg Drugs. 2007 Sep;12(3):423-34. | |||||
| REF 3 | Drugs@FDA. U.S. Food and Drug Administration. U.S. Department of Health & Human Services. 2015 | |||||
| REF 4 | ClinicalTrials.gov (NCT00444769) Dental Pain 3rd Molar Tooth Extraction GW842166. U.S. National Institutes of Health. | |||||
| REF 5 | Clinical pipeline report, company report or official report of the Pharmaceutical Research and Manufacturers of America (PhRMA) | |||||
| REF 6 | ClinicalTrials.gov (NCT04794205) Acute Changes In Thermal Pain Response Following Single Oral Dose of Beta-Cary (BCP-Pain). U.S. National Institutes of Health. | |||||
| REF 7 | Trusted, scientifically sound profiles of drug programs, clinical trials, safety reports, and company deals, written by scientists. Springer. 2015. Adis Insight (drug id 800036909) | |||||
| REF 8 | ClinicalTrials.gov (NCT01544296) A Comparative Study of KHK6188. U.S. National Institutes of Health. | |||||
| REF 9 | ClinicalTrials.gov (NCT01319929) A Study of LY2828360 in Patients With Osteoarthritic Knee Pain. U.S. National Institutes of Health. | |||||
| REF 10 | Emerging drugs for atopic dermatitis. Expert Opin Emerg Drugs. 2009 Mar;14(1):165-79. | |||||
| REF 11 | Clinical pipeline report, company report or official report of Roche | |||||
| REF 12 | Clinical pipeline report, company report or official report of NeuroTherapia | |||||
| REF 13 | Trusted, scientifically sound profiles of drug programs, clinical trials, safety reports, and company deals, written by scientists. Springer. 2015. Adis Insight (drug id 800024918) | |||||
| REF 14 | Cannabinoid receptor 2 (CB2) agonists and antagonists: a patent update.Expert Opin Ther Pat. 2016 Jul;26(7):843-56. | |||||
| REF 15 | Trusted, scientifically sound profiles of drug programs, clinical trials, safety reports, and company deals, written by scientists. Springer. 2015. Adis Insight (drug id 800014615) | |||||
| REF 16 | URL: http://www.guidetopharmacology.org Nucleic Acids Res. 2015 Oct 12. pii: gkv1037. The IUPHAR/BPS Guide to PHARMACOLOGY in 2016: towards curated quantitative interactions between 1300 protein targets and 6000 ligands. (Ligand id: 746). | |||||
| REF 17 | Trusted, scientifically sound profiles of drug programs, clinical trials, safety reports, and company deals, written by scientists. Springer. 2015. Adis Insight (drug id 800021026) | |||||
| REF 18 | Trusted, scientifically sound profiles of drug programs, clinical trials, safety reports, and company deals, written by scientists. Springer. 2015. Adis Insight (drug id 800030875) | |||||
| REF 19 | Trusted, scientifically sound profiles of drug programs, clinical trials, safety reports, and company deals, written by scientists. Springer. 2015. Adis Insight (drug id 800018288) | |||||
| REF 20 | Trusted, scientifically sound profiles of drug programs, clinical trials, safety reports, and company deals, written by scientists. Springer. 2015. Adis Insight (drug id 800021746) | |||||
| REF 21 | Novel 1',1'-chain substituted hexahydrocannabinols: 9-hydroxy-3-(1-hexyl-cyclobut-1-yl)-hexahydrocannabinol (AM2389) a highly potent cannabinoid r... J Med Chem. 2010 Oct 14;53(19):6996-7010. | |||||
| REF 22 | The agonist binding mechanism of human CB2 receptor studied by molecular dynamics simulation, free energy calculation and 3D-QSAR studies. Yao Xue Xue Bao. 2013 Sep;48(9):1436-49. | |||||
| REF 23 | The cannabinoid CB1 receptor-selective phytocannabinoid beta-caryophyllene exerts analgesic effects in mouse models of inflammatory and neuropathic pain. Eur Neuropsychopharmacol. 2014 Apr;24(4):608-20. | |||||
| REF 24 | Company report (Gwpharm) | |||||
| REF 25 | Recent Development of CB2 Selective and Peripheral CB1/CB2 Cannabinoid Receptor Ligands. Current Medicinal Chemistry . 10/2013; 21(2). | |||||
| REF 26 | MDA7: a novel selective agonist for CB2 receptors that prevents allodynia in rat neuropathic pain models. Br J Pharmacol. 2008 Dec;155(7):1104-16. | |||||
| REF 27 | Cannabinoid CB2 receptor (CNR2). SciBX 3(46); doi:10.1038/scibx.2010.1384. Dec. 2 2010 | |||||
| REF 28 | BAY 38-7271: a novel highly selective and highly potent cannabinoid receptor agonist for the treatment of traumatic brain injury.CNS Drug Rev.2003 Winter;9(4):343-58. | |||||
| REF 29 | Brain CB2 Receptors: Implications for Neuropsychiatric Disorders. Pharmaceuticals (Basel) 2010 August; 3(8): 2517-2553. | |||||
| REF 30 | Cerebroprotective effects of TAK-937, a cannabinoid receptor agonist, on ischemic brain damage in middle cerebral artery occluded rats and non-human primates. Brain Res. 2012 Jan 9;1430:93-100. | |||||
| REF 31 | Trusted, scientifically sound profiles of drug programs, clinical trials, safety reports, and company deals, written by scientists. Springer. 2015. Adis Insight (drug id 800018288) | |||||
| REF 32 | Targeting CB2 receptors and the endocannabinoid system for the treatment of pain. Brain Res Rev. 2009 April; 60(1): 255-266. | |||||
| REF 33 | URL: http://www.guidetopharmacology.org Nucleic Acids Res. 2015 Oct 12. pii: gkv1037. The IUPHAR/BPS Guide to PHARMACOLOGY in 2016: towards curated quantitative interactions between 1300 protein targets and 6000 ligands. (Target id: 57). | |||||
| REF 34 | Synthesis and cannabinoid activity of 1-substituted-indole-3-oxadiazole derivatives: novel agonists for the CB1 receptor. Eur J Med Chem. 2008 Mar;43(3):513-39. | |||||
| REF 35 | Conformationally constrained fatty acid ethanolamides as cannabinoid and vanilloid receptor probes. J Med Chem. 2009 May 14;52(9):3001-9. | |||||
| REF 36 | Dihydro-pyrano[2,3-b]pyridines and tetrahydro-1,8-naphthyridines as CB1 receptor inverse agonists: synthesis, SAR and biological evaluation. Bioorg Med Chem Lett. 2010 Jun 15;20(12):3750-4. | |||||
| REF 37 | Discovery of benzhydrylpiperazine derivatives as CB1 receptor inverse agonists via privileged structure-based approach. Eur J Med Chem. 2010 Mar;45(3):1133-9. | |||||
| REF 38 | New metabolically stable fatty acid amide ligands of cannabinoid receptors: Synthesis and receptor affinity studies. Bioorg Med Chem Lett. 2006 Jan 1;16(1):138-41. | |||||
| REF 39 | Tricyclic pyrazoles. 3. Synthesis, biological evaluation, and molecular modeling of analogues of the cannabinoid antagonist 8-chloro-1-(2',4'-dichl... J Med Chem. 2005 Nov 17;48(23):7351-62. | |||||
| REF 40 | Biaryl cannabinoid mimetics--synthesis and structure-activity relationship. Bioorg Med Chem Lett. 2007 Jul 1;17(13):3652-6. | |||||
| REF 41 | Synthesis and pharmacological evaluation of coumarin derivatives as cannabinoid receptor antagonists and inverse agonists. Bioorg Med Chem. 2009 Apr 1;17(7):2842-51. | |||||
| REF 42 | Novel 3,4-diarylpyrazolines as potent cannabinoid CB1 receptor antagonists with lower lipophilicity. Bioorg Med Chem Lett. 2005 Nov 1;15(21):4794-8. | |||||
| REF 43 | Pharmacomodulations around the 4-oxo-1,4-dihydroquinoline-3-carboxamides, a class of potent CB2-selective cannabinoid receptor ligands: consequence... J Med Chem. 2007 Nov 1;50(22):5471-84. | |||||
| REF 44 | New tetrazole-based selective anandamide uptake inhibitors. Bioorg Med Chem Lett. 2008 May 1;18(9):2820-4. | |||||
| REF 45 | Indol-3-ylcycloalkyl ketones: effects of N1 substituted indole side chain variations on CB(2) cannabinoid receptor activity. J Med Chem. 2010 Jan 14;53(1):295-315. | |||||
| REF 46 | Cannabilactones: a novel class of CB2 selective agonists with peripheral analgesic activity. J Med Chem. 2007 Dec 27;50(26):6493-500. | |||||
| REF 47 | New analgesics synthetically derived from the paracetamol metabolite N-(4-hydroxyphenyl)-(5Z,8Z,11Z,14Z)-icosatetra-5,8,11,14-enamide. J Med Chem. 2008 Dec 25;51(24):7800-5. | |||||
| REF 48 | Heteroadamantyl cannabinoids. J Med Chem. 2010 Aug 12;53(15):5656-66. | |||||
| REF 49 | New 1,8-naphthyridine and quinoline derivatives as CB2 selective agonists. Bioorg Med Chem Lett. 2007 Dec 1;17(23):6505-10. | |||||
| REF 50 | Bornyl- and isobornyl-Delta8-tetrahydrocannabinols: a novel class of cannabinergic ligands. J Med Chem. 2008 Oct 23;51(20):6393-9. | |||||
| REF 51 | Self-assembling cannabinomimetics: supramolecular structures of N-alkyl amides. J Nat Prod. 2007 Jun;70(6):1010-5. | |||||
| REF 52 | Discovery of novel CB2 receptor ligands by a pharmacophore-based virtual screening workflow. J Med Chem. 2009 Jan 22;52(2):369-78. | |||||
| REF 53 | Design, synthesis, and biological evaluation of new 1,8-naphthyridin-4(1H)-on-3-carboxamide and quinolin-4(1H)-on-3-carboxamide derivatives as CB2 ... J Med Chem. 2006 Oct 5;49(20):5947-57. | |||||
| REF 54 | 1-Alkyl-2-aryl-4-(1-naphthoyl)pyrroles: new high affinity ligands for the cannabinoid CB1 and CB2 receptors. Bioorg Med Chem Lett. 2006 Oct 15;16(20):5432-5. | |||||
| REF 55 | 1-Pentyl-3-phenylacetylindoles, a new class of cannabimimetic indoles. Bioorg Med Chem Lett. 2005 Sep 15;15(18):4110-3. | |||||
| REF 56 | Synthesis and pharmacology of 1-deoxy analogs of CP-47,497 and CP-55,940. Bioorg Med Chem. 2008 Jan 1;16(1):322-35. | |||||
| REF 57 | Synthesis and pharmacology of 1-methoxy analogs of CP-47,497. Bioorg Med Chem. 2010 Aug 1;18(15):5475-82. | |||||
| REF 58 | Exploring the substituent effects on a novel series of C1'-dimethyl-aryl Delta8-tetrahydrocannabinol analogs. Bioorg Med Chem. 2008 Jul 1;16(13):6489-500. | |||||
| REF 59 | Novel sterically hindered cannabinoid CB1 receptor ligands. Bioorg Med Chem. 2008 Aug 1;16(15):7510-5. | |||||
| REF 60 | Oxyhomologues of anandamide and related endolipids: chemoselective synthesis and biological activity. J Med Chem. 2006 Apr 6;49(7):2333-8. | |||||
| REF 61 | CB2 selective sulfamoyl benzamides: optimization of the amide functionality. Bioorg Med Chem Lett. 2009 Jan 15;19(2):309-13. | |||||
| REF 62 | Discovery of N-[(4R)-6-(4-chlorophenyl)-7-(2,4-dichlorophenyl)-2,2-dimethyl-3,4-dihydro-2H-pyrano[2,3-b]pyridin-4-yl]-5-methyl-1H-pyrazole-3-carbox... J Med Chem. 2010 May 27;53(10):4028-37. | |||||
| REF 63 | Synthesis of functionalized 1,8-naphthyridinones and their evaluation as novel, orally active CB1 receptor inverse agonists. Bioorg Med Chem Lett. 2006 Feb;16(3):681-5. | |||||
| REF 64 | Morpholinoalkylindenes as antinociceptive agents: Novel cannabinoid receptor agonists, Bioorg. Med. Chem. Lett. 5(4):381-386 (1995). | |||||
| REF 65 | Radiosynthesis of novel carbon-11-labeled triaryl ligands for cannabinoid-type 2 receptor. Bioorg Med Chem Lett. 2010 Mar 1;20(5):1565-8. | |||||
| REF 66 | Synthesis and SAR of novel imidazoles as potent and selective cannabinoid CB2 receptor antagonists with high binding efficiencies. Bioorg Med Chem Lett. 2010 Feb 1;20(3):1084-9. | |||||
| REF 67 | Antinociceptive activity of the endogenous fatty acid amide, palmitylethanolamide. Eur J Pharmacol. 2001 May 11;419(2-3):191-8. | |||||
| REF 68 | Fatty acid amide hydrolase inhibitors. Surprising selectivity of chiral azetidine ureas. Bioorg Med Chem Lett. 2009 Aug 1;19(15):4241-4. | |||||
| REF 69 | Signaling pathway associated with stimulation of CB2 peripheral cannabinoid receptor. Involvement of both mitogen-activated protein kinase and induction of Krox-24 expression. Eur J Biochem. 1996 May1;237(3):704-11. | |||||
| REF 70 | Tricyclic pyrazoles. 4. Synthesis and biological evaluation of analogues of the robust and selective CB2 cannabinoid ligand 1-(2',4'-dichlorophenyl... J Med Chem. 2006 Dec 14;49(25):7502-12. | |||||
| REF 71 | The peripheral cannabinoid receptor: adenylate cyclase inhibition and G protein coupling. FEBS Lett. 1995 Nov 13;375(1-2):143-7. | |||||
| REF 72 | Activation of the human peripheral cannabinoid receptor results in inhibition of adenylyl cyclase. Mol Pharmacol. 1995 Aug;48(2):352-61. | |||||
| REF 73 | Cryo-EM Structure of the Human Cannabinoid Receptor CB2-G(i) Signaling Complex. Cell. 2020 Feb 20;180(4):645-654.e13. | |||||
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